3-chloranyl-N-[(2-dodecyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]benzamide

Systemtic Name: 3-chloranyl-N-[(2-dodecyl-1,2,3,4-tetrazol-5-yl)-phenyl-methyl]benzamide Openeye Name: 3-chloro-N-[(2-dodecyltetrazol-5-yl)-phenyl-methyl]benzamide CAS Name: 3-chloro-N-[(2-dodecyl-5-tetrazolyl)-phenylmethyl]benzamide IUPAC Name: 3-chloro-N-[(2-dodecyltetrazol-5-yl)-phenylmethyl]benzamide Traditional Name: 3-chloro-N-[(2-lauryltetrazol-5-yl)-phenyl-methyl]benzamide Formula: C27H36ClN5O MolecularWeight: 482.06064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1N=C(N=N1)C(C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCN1N=C(N=N1)C(C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C27H36ClN5O/c1-2-3-4-5-6-7-8-9-10-14-20-33-31-26(30-32-33)25(22-16-12-11-13-17-22)29-27(34)23-18-15-19-24(28)21-23/h11-13,15-19,21,25H,2-10,14,20H2,1H3,(H,29,34)